2-氯-N-甲基苯胺
TL;DR: 2-氯-N-甲基苯胺 (CAS 1187385-64-3) is a chemical compound with molecular formula CNC1=CC=CC=C1Cl and molecular weight 141.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氯-N-甲基苯胺
2-chloro-N-methylaniline
Also Known As: 2-Chloro-N-methylaniline, acarbose, N-Methyl-2-chloroaniline, Benzenamine, 2-chloro-N-methyl-, 2-chloro-N-methyl-aniline
| Molecular Formula | CNC1=CC=CC=C1Cl |
|---|---|
| Molecular Weight | 141.03 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 141.03453 |
| Heavy Atoms | 9 |
| Complexity | 85.0 |
Chemical Identifiers
| CAS Number | 1187385-64-3 |
|---|---|
| SMILES | CNC1=CC=CC=C1Cl |
| InChIKey | WGNNILPYHCKCFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氯-N-甲基苯胺 (CAS 1187385-64-3), with molecular formula CNC1=CC=CC=C1Cl and molecular weight 141.03 g/mol. IUPAC: 2-chloro-N-methylaniline.
Chemical Property Profile of 2-氯-N-甲基苯胺
Property Insights of 2-氯-N-甲基苯胺
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氯-N-甲基苯胺. With a topological polar surface area (TPSA) of 12.0 Ų, 2-氯-N-甲基苯胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氯-N-甲基苯胺 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-氯-N-甲基苯胺?
The CAS number of 2-氯-N-甲基苯胺 is 1187385-64-3.
What is the molecular formula of 2-氯-N-甲基苯胺?
The molecular formula of 2-氯-N-甲基苯胺 is CNC1=CC=CC=C1Cl.
What is the molecular weight of 2-氯-N-甲基苯胺?
The molecular weight of 2-氯-N-甲基苯胺 is 141.03 g/mol.
Where can I buy 2-氯-N-甲基苯胺?
You can request a quote for 2-氯-N-甲基苯胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氯-N-甲基苯胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氯-N-甲基苯胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.